SCHEMBL7979698

SCHEMBL7979698

COC(=O)c1sc(C)c(C#N)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
KDM4E B2RXH2 5/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HPGD P15428 4/20 0.45
GAA P10253 3/20 0.45
ADORA2A P29274 1/20 0.44
HSD17B10 Q99714 4/20 0.44
GLA P06280 2/20 0.44
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALOX15 P16050 1/20 0.44
ATM Q13315 1/20 0.44
MELK Q14680 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.40
HTT P42858 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3135234 0.85 L3MBTL1 (0.58) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1
SCHEMBL9097378 0.82 MELK (0.41) ALDH1A1KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL18430437 0.82 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1
SCHEMBL7021001 0.80 MAPT (0.52) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL27469752 0.79 KMT2A (0.40) ALDH1A1KDM4EMAPTRXFP1HPGD
SCHEMBL3401657 0.79 GRIA4 (0.45) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1
SCHEMBL5642877 0.78 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTHPGDGAA
SCHEMBL3404543 0.78 GRIA2 (0.42) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1
SCHEMBL7982273 0.78 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1
SCHEMBL4471909 0.76 MELK (0.60) ALDH1A1KDM4EMAPTSMN1; SMN2RXFP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225310-B1 Fused 1,2,4-thiadiazine derivatives, their preparation and use NOVO NORDISK A/S (DK) 2001-05-01 US disclosed
EP-1000066-A1 FUSED 1,2,4-THIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-05-17 EP disclosed
WO-1999003861-A1 FUSED 1,2,4-THIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-01-28 WO disclosed
EP-0609371-B1 THIENOPYRAZINE-2,3-DIONES USEFUL FOR TREATING CNS DISORDERS, AND THEIR PREPARATION. NOVO NORDISK AS (DK) 1996-04-24 EP disclosed
EP-0483683-B1 Thienoimidazole derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-02-28 EP disclosed
US-5463073-A Angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-31 US disclosed
EP-0609371-A1 THIENOPYRAZINE-2,3-DIONES AND THEIR PREPARATION AND USE. NOVO NORDISK AS (DK) 1994-08-10 EP disclosed
US-5284847-A Neurological and psychological disorders; antagonist at the glycine binding site on the N-methyl-D-aspartate receptor complex NOVO NORDISK A/S (DK) 1994-02-08 US disclosed
WO-1993008197-A1 THIENOPYRAZINE-2,3-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-04-29 WO disclosed
EP-0315899-B1 THIEN-3-YL AZO DYES BASF Aktiengesellschaft (DE) 1993-04-07 EP disclosed
EP-0483683-A2 Thienoimidazole derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1992-05-06 EP disclosed
US-4994564-A Dyeing synthetic fibers in shades of red, yellow BASF AKTIENGESELLSCHAFT (DE) 1991-02-19 US disclosed
EP-0315899-A2 Thien-3-yl azo dyes BASF Aktiengesellschaft (DE) 1989-05-17 EP disclosed